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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:18 UTC
Update Date2025-03-25 00:50:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183724
Frequency0.5
Structure
Chemical FormulaC15H8O7
Molecular Mass300.027
SMILESO=c1occ2c3c(c(O)c(O)cc13)Oc1cc(O)cc(O)c1-2
InChI KeyJFBSBNORKGWPHU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent xanthenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 2-benzopyrans
  • benzenoids
  • diarylethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • isocoumarins and derivatives
  • lactones
  • organic oxides
  • oxacyclic compounds
  • pyranones and derivatives
  • Substituents
  • diaryl ether
  • ether
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • isocoumarin
  • xanthene
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • 2-benzopyran
  • pyranone
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound